Geometry & MOs

Info

ID:	206756
PubChem CID:	80296101
Reduced:	ON3C14H19 (1)
Stoich.:	AB3C14D19 (1)
Weight, g/mol:	260.104003
ΔH_f, kcal/mol:	-3.88
Dipole, Da:	1.07
IP(EA), eV:	-8.78(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino]methyl]pentan-1-ol

Drug info:

PubChemData

Smile

CCC(CCO)CNC1=NC2=CC=CC=C2N=C1

DOS

IR

Vibrations